Structure of PDB 5s5a Chain E Binding Site BS01

Receptor Information
>5s5a Chain E (length=123) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MEVIELNKCTSGQSFEVILKPPSDPSLEEIQKKLEAAEERRKYQEAELLK
HLAEKREHEREVIQKAIEENNNFIKMAKEKLAQKMESNKENREAHLAAML
ERLQEKDKHAEEVRKNKELKEEA
Ligand information
Ligand IDWZY
InChIInChI=1S/C9H12N2O2/c1-13-8-4-2-7(3-5-8)11-9(12)6-10/h2-5H,6,10H2,1H3,(H,11,12)
InChIKeyMAVJTZKUNOKGPF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7COc1ccc(cc1)NC(=O)CN
ACDLabs 12.01N(c1ccc(cc1)OC)C(CN)=O
CACTVS 3.385COc1ccc(NC(=O)CN)cc1
FormulaC9 H12 N2 O2
NameN-(4-methoxyphenyl)glycinamide
ChEMBL
DrugBank
ZINCZINC000001566885
PDB chain5s5a Chain E Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5s5a Comprehensive Analysis of Binding Sites in Tubulin.
Resolution2.35 Å
Binding residue
(original residue number in PDB)		R112 L116 M119
Binding residue
(residue number reindexed from 1)		R92 L96 M99
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0031110 regulation of microtubule polymerization or depolymerization

View graph for
Biological Process
External links
PDB RCSB:5s5a, PDBe:5s5a, PDBj:5s5a
PDBsum5s5a
PubMed33951246
UniProtP63043|STMN4_RAT Stathmin-4 (Gene Name=Stmn4)

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